SCHEMBL20560979

SCHEMBL20560979

C[C@]1(C(=O)O)CCC[C@]2(C)c3cc(OS(=O)(=O)C(F)(F)F)ccc3CC[C@@H]12

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 4/20 0.73
NR1H2 P55055 7/20 0.64
NR1H3 Q13133 7/20 0.64
KARS1 Q15046 2/20 0.56
POLB P06746 1/20 0.56
APEX1 P27695 1/20 0.56
PDE4D Q08499 1/20 0.56
NR1I2 O75469 1/20 0.55
OPRK1 P41145 1/20 0.55
RXRA P19793 1/20 0.54
CCNE1 P24864 1/20 0.54
CDK2 P24941 1/20 0.54
RXRB P28702 1/20 0.54
RXRG P48443 1/20 0.54
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
CYP2C19 P33261 1/20 0.51
CYP3A4 P08684 1/20 0.51
PTPN1 P18031 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20561235 0.92 NR1H2 (0.70) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL31678855 0.92 NR1H2 (0.70) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL29295276 0.91 POLA1 (0.63) POLA1NR1H2NR1H3CYP2C9TSHR
SCHEMBL20561209 0.91 POLA1 (0.63) POLA1NR1H2NR1H3CYP2C9TSHR
SCHEMBL20561208 0.91 POLA1 (0.63) POLA1NR1H2NR1H3CYP2C9TSHR
SCHEMBL13208236 0.86 LMNA (0.62) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL280198 0.85 POLA1 (1.00) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL5510769 0.85 POLA1 (1.00) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL12872352 0.85 POLA1 (1.00) POLA1NR1H2NR1H3KARS1POLB
SCHEMBL20561210 0.84 POLA1 (0.51) POLA1NR1H2NR1H3KARS1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883926-B1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDE DERIVATIVES AND PROTEIN CONJUGATES THEREOF FOR USE AS LXR AGONISTS REGENERON PHARMA (US) 2024-07-10 EP disclosed
US-20230079407-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. 2023-03-16 US disclosed
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2023-02-02 US disclosed
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof REGENERON PHARMACEUTICALS, INC. (US) 2022-07-05 US disclosed
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2022-04-14 US disclosed
EP-3790899-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2021-03-17 EP disclosed
WO-2019217591-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2019-11-14 WO disclosed
US-20180333504-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES REGENERON PHAMACEUTICALS, INC. 2018-11-22 US disclosed
US-20180334426-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2018-11-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180334426-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR POLA1 2752/4885NR1H2 4/4885NR1H3 2/4885
US-20230079407-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF CD47, MSR1, LDLR POLA1 2693/4885NR1H2 195/4885NR1H3 128/4885
US-20180333504-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES SDCBP, DDOST, KRTCAP2 POLA1 4011/4885NR1H2 1304/4885NR1H3 1332/4885
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR POLA1 2752/4885NR1H2 4/4885NR1H3 2/4885
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES SDCBP, DDOST, KRTCAP2 POLA1 4011/4885NR1H2 1304/4885NR1H3 1332/4885
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof CD47, MSR1, LDLR POLA1 2693/4885NR1H2 195/4885NR1H3 128/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.